| Complex | diCu CCDC=978345 |
|---|---|
| Empirical formula | C30H28N2CuO5 |
| Formula weight | 560.08 |
| Temperature (K) | 173(2) |
| Crystal system | Monoclinic |
| Space group | P21(#4) |
| a (Å) | 12.3063(17) |
| b (Å) | 9.5429(13) |
| c (Å) | 22.516(3) |
| α(°) | |
| β(°) | 98.227(2) |
| γ(°) | |
| V (Å 3) | 2617.0(6) |
| Z | 4 |
| Crystal size (mm) | 0.14 0.10 0.06 |
| Density (calculated) (g/cm-3) | 1.422 |
| Absorption coefficient (mm-1) | 0.878 |
| F(000) | 1164 |
| θrange for data collection(°) | 2.29 to 27.52 |
| Limiting indices | -9<=h<=15, -12<=k<=11, -29<=l<=29 |
| Reflections collected | 14028 |
| Independent reflections | 9632 [R(int) = 0.0280] |
| Completeness to θ | 99.0 % |
| Refinement method | Full-matrix least-squares on F2 |
| Data/restraints/parameters | 9632 / 1 / 705 |
| Goodness-of-fit on F2 | 0.930 |
| Final R indices [I>2sigma(I)] | R1 = 0.0335, wR2 = 0.0799 |
| R indices (all data) | R1 = 0.0494, wR2 = 0.0877 |
| Absolute structure parameter | -0.024(10) |
| Largest diff. peak and hole (e Å-3) | 0.396 and -0.446 |